• 
  [Synonyms]
  LS-148411
  4-Phenyl-3-(p-tolyl)sydnone imine monohydrochloride
  N-(p-Tolyl)-C-(phenyl)-sydnonimin hydrochlorid [German]
  Sydnone imine, 4-phenyl-3-(p-tolyl)-, monohydrochloride
  3483-22-5
  
  [Structure]
  
  
  
  [ Properties Computed from Structure]
  

  Molecular Weight	287.74416 [g/mol]
  Molecular Formula	C15H14ClN3O
  H-Bond Donor	1
  H-Bond Acceptor	4
  Rotatable Bond Count	2
  Tautomer Count	2
  Exact Mass	287.08254
  MonoIsotopic Mass	287.08254
  Topological Polar Surface Area	53.8
  Heavy Atom Count	20
  Formal Charge	0
  Complexity	421
  Isotope Atom Count	0
  Defined Atom StereoCenter Count	0
  Undefined Atom StereoCenter Count	0
  Defined Bond StereoCenter Count	0
  Undefined Bond StereoCenter Count	0
  Covalently-Bonded Unit Count	2

  
  [ Descriptors Computed from Structure]
  IUPAC Name: 5-methyl-2-(4-phenyloxadiazol-3-ium-3-yl)cyclohexa-2,4-dien-1-imine
  chloride
  Canonical SMILES: CC1=CC=C(C(=N)C1)[N+]2=NOC=C2C3=CC=CC=C3.[Cl-]
  InChI: InChI=1/C15H14N3O.ClH/c1-11-7-8-14(13(16)9-11)18-15(10-19-17-18)12-5-3-
  2-4-6-12;/h2-8,10,16H,9H2,
  1H3;1H/q+1;/p-1/b16-13+;/fC15H14N3O.Cl/h;1h/qm;-1